| SpectraBase Compound ID | 7D0ehJZOzVo |
|---|---|
| InChI | InChI=1S/C35H54O7/c1-21-12-17-35(29(38)40-9)19-18-32(6)24(28(35)34(21,8)39)10-11-26-30(4)15-14-27(42-23(3)37)31(5,20-41-22(2)36)25(30)13-16-33(26,32)7/h10,21,25-28,39H,11-20H2,1-9H3/t21-,25?,26?,27-,28?,30-,31-,32+,33+,34+,35-/m0/s1 |
| InChIKey | CABQUSYDWFZFIE-NGQPFXILSA-N |
| Mol Weight | 586.8 g/mol |
| Molecular Formula | C35H54O7 |
| Exact Mass | 586.386954 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DtoBYDWmXXS |
|---|---|
| Name | METHYL-DIACETYLROTUNDATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O7 |
| InChI | InChI=1S/C35H54O7/c1-21-12-17-35(29(38)40-9)19-18-32(6)24(28(35)34(21,8)39)10-11-26-30(4)15-14-27(42-23(3)37)31(5,20-41-22(2)36)25(30)13-16-33(26,32)7/h10,21,25-28,39H,11-20H2,1-9H3/t21-,25?,26?,27-,28?,30-,31-,32+,33+,34+,35-/m0/s1 |
| InChIKey | CABQUSYDWFZFIE-NGQPFXILSA-N |
| Literature Reference Author | J.SAKAKIBARA,T.KAIYA,H.FUKUDA |
| Literature Reference Citation | PHYTOCHEM.,23,627(1984) |
| Literature Reference DOI | 10.1016/S0031-9422(00)80395-7 |
| Molecular Weight | 586.810 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK376 |